We apply a method that combines the tight-binding approximation and the Lö wdin down-folding procedure to evaluate the electronic band structure of the newly discovered pressure-induced superconductor CrAs. By integrating out all low-lying arsenic degrees of freedom, we derive an effective Hamiltonian model describing the Cr d bands near the Fermi level. We calculate and make predictions for the energy spectra, the Fermi surface, the density of states and transport and magnetic properties of this compound. Our results are consistent with local-density approximation calculations and they also show good agreement with available experimental data for resistivity and the Cr magnetic moment
Density functional theory calculations using the pseudopotential-plane-wave approach are employed to...
We have studied the effects of transition-metal Cr in excess on the electronic and magnetic properti...
The crystal structure of CrAs was investigated using synchrotron X-ray single-crystal diffraction fo...
We apply a method that combines the tight-binding approximation and the Lö wdin down-folding procedu...
We present the effects of spin-orbit coupling on the low-energy bands and Fermi surface of the recen...
We present the effects of spin-orbit coupling on the low-energy bands and Fermi surface of the recen...
In the ongoing and wide-ranging efforts to understand superconductivity and its interplay with magne...
Chromium Arsenide (CrAs) is the first Cr-based superconductor, exhibiting pressure-induced supercond...
Chromium Arsenide (CrAs) is the first reported Cr-based superconductor, exhibiting superconductivity...
We study the tight-binding dispersion of the recently discovered superconductor K2Cr3As3, obtained f...
We present a systematic derivation of a minimal five-band tight-binding model for the description of...
We report resistivity measurements of a CrAs single crystal in a wide temperature range, with the sp...
Among intermetallic compounds between 3d transition metals and pnictogens, compounds containing chro...
Density functional theory calculations using the pseudopotential-plane-wave approach are employed to...
We have studied the effects of transition-metal Cr in excess on the electronic and magnetic properti...
The crystal structure of CrAs was investigated using synchrotron X-ray single-crystal diffraction fo...
We apply a method that combines the tight-binding approximation and the Lö wdin down-folding procedu...
We present the effects of spin-orbit coupling on the low-energy bands and Fermi surface of the recen...
We present the effects of spin-orbit coupling on the low-energy bands and Fermi surface of the recen...
In the ongoing and wide-ranging efforts to understand superconductivity and its interplay with magne...
Chromium Arsenide (CrAs) is the first Cr-based superconductor, exhibiting pressure-induced supercond...
Chromium Arsenide (CrAs) is the first reported Cr-based superconductor, exhibiting superconductivity...
We study the tight-binding dispersion of the recently discovered superconductor K2Cr3As3, obtained f...
We present a systematic derivation of a minimal five-band tight-binding model for the description of...
We report resistivity measurements of a CrAs single crystal in a wide temperature range, with the sp...
Among intermetallic compounds between 3d transition metals and pnictogens, compounds containing chro...
Density functional theory calculations using the pseudopotential-plane-wave approach are employed to...
We have studied the effects of transition-metal Cr in excess on the electronic and magnetic properti...
The crystal structure of CrAs was investigated using synchrotron X-ray single-crystal diffraction fo...